(Z)-3-cyano-2-phenylprop-2-enamide
Formula:C10H8N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-3-cyano-2-phenylprop-2-enamide is a drug-like molecule.
| MolName | (Z)-3-cyano-2-phenylprop-2-enamide |
| MolecularFormula | C10H8N2O |
| Smiles | NC(/C(/c1ccccc1)=C\C#N)=O |
| InChI | InChI=1S/C10H8N2O/c11-7-6-9(10(12)13)8-4-2-1-3-5-8/h1-6H,(H2,12,13) |
| InChIK | ACSIXTNLSYCMDY-UHFFFAOYSA-N |
| TotalMolweight | 172.187 |
| Molweight | 172.187 |
| MonoisotopicMass | 172.063663 |
| CLogP | 0.5421 |
| CLogS | -1.952 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 145.95 |
| Relative PSA | 0.28688 |
| PolarSurfaceArea | 66.88 |
| Druglikeness | -3.0198 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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